N-[(1R)-1-(4-bromophenyl)ethyl]-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(1R)-1-(4-bromophenyl)ethyl]-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[(1R)-1-(4-bromophenyl)ethyl]-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(1R)-1-(4-bromophenyl)ethyl]-2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(1R)-1-(4-bromophenyl)ethyl]-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[(1R)-1-(4-bromophenyl)ethyl]-2-[4-(2-furoyl)piperazin-1-ium-1-yl]acetamide Formula: C19H23BrN3O3+ MolecularWeight: 421.30822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Br)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CO3

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)Br)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CO3

InChI

InChI=1S/C19H22BrN3O3/c1-14(15-4-6-16(20)7-5-15)21-18(24)13-22-8-10-23(11-9-22)19(25)17-3-2-12-26-17/h2-7,12,14H,8-11,13H2,1H3,(H,21,24)/p+1/t14-/m1/s1